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4-Bromo-2-(Methylthionyl)Pyrimidine

    • Product Name 4-Bromo-2-(Methylthionyl)Pyrimidine
    • Alias 4-Bromo-2-(Methylthio)pyrimidine
    • Einecs 84627-94-3
    • Mininmum Order 1 g
    • Factory Site Tengfei Creation Center,55 Jiangjun Avenue, Jiangning District,Nanjing
    • Price Inquiry admin@sinochem-nanjing.com
    • Manufacturer Sinochem Nanjing Corporation
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    Specifications

    HS Code

    685498

    Chemical Name 4-Bromo-2-(Methylthio)pyrimidine
    Molecular Formula C5H5BrN2S
    Molecular Weight 205.08 g/mol
    Cas Number 6632-96-4
    Appearance Off-white to light yellow solid
    Melting Point 70-74°C
    Purity Typically ≥98%
    Solubility Soluble in DMSO, DMF, and partially in methanol
    Boiling Point 294°C at 760 mmHg (estimated)
    Density 1.76 g/cm³ (estimated)
    Smiles CSC1=NC=NC(Br)=C1
    Inchi InChI=1S/C5H5BrN2S/c1-9-5-7-2-4(6)8-3-5/h2-3H,1H3
    Storage Conditions Store at 2-8°C, dry and well-sealed

    As an accredited 4-Bromo-2-(Methylthionyl)Pyrimidine factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.

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    Application of 4-Bromo-2-(Methylthionyl)Pyrimidine

    Applications of 4-Bromo-2-(Methylthionyl)Pyrimidine in Industrial Manufacturing

    4-Bromo-2-(Methylthionyl)Pyrimidine serves as a specialized intermediate in the synthesis of complex organic molecules across advanced industrial segments. As the original manufacturer, we deliver this material to customers who require traceable, high-purity intermediates for tightly regulated processes, focusing on established applications supported by market demand and verifiable downstream usage. Below, we outline its principal industrial applications, each governed by relevant standards, practical usage experience, formulation data, and integration into certified production operations.

    1. Pharmaceutical API Intermediate for Antiviral Drug Synthesis

    Research-based pharmaceutical manufacturers procure this material as a nucleoside precursor for the targeted assembly of select antiviral drug candidates. In cGMP-compliant plants, it participates in protected condensation and heterocyclic modification steps to construct pyrimidine analogs critical for small-molecule active pharmaceutical ingredients. Downstream process engineers optimize input amounts based on reaction stoichiometry and regulatory validation batches, especially in pilot-to-commercial scale-up. Batch release triggers extensive analytical testing to meet monograph criteria for API intermediates and avoid downstream impurity carryover.

    Industry compliance standards

    • ICH Q7A Good Manufacturing Practice for Active Pharmaceutical Ingredients
    • EU GMP Directive (EudraLex Volume 4)
    • 21 CFR Part 211 (US FDA cGMP for Finished Pharmaceuticals)
    • USP–NF and EP monograph pre-approval requirements for intermediates

    Typical usage ratio

    • Ranges from 0.7 to 1.1 molar equivalents in stepwise pyrimidine coupling; adjusted based on impurity profile and conversion yield in pilot and commercial lots

    Downstream process integration

    • Charged into synthesis reactors during early-stage N-substituted pyrimidine intermediate stage, following raw material authentication and in-line QC sampling

    Final product types

    • Antiviral small-molecule APIs, including modified pyrimidine nucleoside analogs
    • Pharmaceutical intermediate lots submitted for regulatory validation

    2. Agrochemical Pyrimidine-Based Herbicide Intermediate

    Multinational crop protection formulators utilize this compound as a stepwise intermediate in the synthesis of pyrimidine class herbicides. During scale production, process engineers implement precise charge and reaction conditions to maximize conversion into the desired substituted pyrimidinyl structure, monitoring closely for off-target byproducts. Each step adheres to strict local and international controls on chemical use and environmental discharge, as formulation must ultimately pass quality and stability testing before downstream blending and packaging.

    Industry compliance standards

    • OECD Principles of Good Laboratory Practice (GLP) for pesticide active ingredient development
    • FAO/WHO guidelines on technical grade active ingredient specifications
    • EU Plant Protection Products Regulation (EC) No 1107/2009
    • US EPA 40 CFR Part 158 Data Requirements for Pesticide Registration

    Typical usage ratio

    • 0.9 to 1.0 molar equivalents, optimized per batch for maximum yield with minimal side-products, governed by downstream quality agreement

    Downstream process integration

    • Introduced directly after initial halogenation or methylthionylation step; monitored for assay and impurity level pre-fractionation

    Final product types

    • Pyrimidine-derived herbicide active ingredients used in systemic weed control
    • Crop protection technical concentrates

    3. Custom Synthesis Building Block in Medicinal Chemistry SAR Programs

    Integrated drug discovery centers and contract research organizations source this compound as a key fragment for structure–activity relationship (SAR) exploration of heterocyclic lead compounds. Researchers utilize tightly controlled those quantities under project-specific protocols. Demand links directly to downstream library synthesis programs where customized functionalization and substitution patterns depend on the desired biological screening outcome. Analytical and data traceability requirements ensure compliance with project sponsors’ intellectual property and raw material origin controls.

    Industry compliance standards

    • ISO 9001:2015 Quality Management for custom synthesis and chemical R&D
    • Compliance with sponsor’s confidentiality and traceability agreements
    • Applicable institutional chemical safety regulations
    • Local chemical handling, inventory, and waste regulations

    Typical usage ratio

    • 0.05–0.15 molar scale per diversified synthesis; adjusted based on target compound structure and the number of test reactions performed

    Downstream process integration

    • Dosed in parallel synthesis reactions as a core fragment input in combinatorial chemistry or SAR study campaigns, followed by stepwise derivatization

    Final product types

    • Diverse heterocyclic compound libraries for biological screening
    • Lead compounds for preclinical candidate nomination

    4. Fine Chemical Intermediate for Industrial Dye Synthesis

    Specialty colorant manufacturers integrate this pyrimidine derivative within the multi-step production of nitrogen-containing industrial dyes, where it enables introduction of specific functional groups to the chromophore scaffold. Handling at this stage requires strict monitoring for dust, emissions, and quality assurance to meet downstream end-use requirements, particularly for applications involving materials that undergo wear or solvent exposure. Only formulations and production routes validated by industry standards achieve commercial viability, necessitating precise input control and trace documentation in all reaction stages.

    Industry compliance standards

    • REACH Regulation (EC) No 1907/2006 for chemical substances registration in the European Union
    • ISO 9001:2015 Certified Quality Management Systems for fine chemicals
    • Oeko-Tex® Standard 100 (where dyes are for textile applications)
    • ZDHC Manufacturing Restricted Substances List (applicable textile chain)

    Typical usage ratio

    • 0.8 to 1.0 molar equivalent for targeted dye molecule synthesis, adjusted based on desired chromophore type and final purity grade

    Downstream process integration

    • Fed into batch dye synthesis post-initial aromatic substitution phase; process tracked for trace metals, purity, and structural verification prior to downstream reactions and blending

    Final product types

    • Pyrimidine-substituted industrial dyes for specialty textiles, inks, and coatings
    • Custom colorant intermediates for specialty application batches
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    More Introduction

    4-Bromo-2-(Methylthionyl)Pyrimidine: A Closer Look at Its Value and Role in Modern Chemistry

    Where 4-Bromo-2-(Methylthionyl)Pyrimidine Fits in Today’s Chemical Landscape

    Working with chemical compounds over the years has sharpened my appreciation for standout tools in the lab. 4-Bromo-2-(methylthionyl)pyrimidine (sometimes simply described by researchers as “the brominated methylthio pyrimidine”) attracts attention for very practical reasons. Chemists in both research and industry settings keep an eye out for reagents that open up more possibilities at the bench. This specific pyrimidine isn’t just another link in the synthetic chemist’s toolbox: it offers reactivity, selectivity, and a chance to design more complex molecules with a streamlined process.

    I’ve watched projects flounder because the core building blocks lacked the right combination of reactivity and stability. In contrast, compounds like 4-Bromo-2-(methylthionyl)pyrimidine help synthetic work move forward, especially when aiming for precision. Pharmaceutical research teams value this because a minor change in a heterocycle can steer an entire project’s outcome. Many people outside these fields never realize just how one choice of reagent can influence costs and timelines down the road.

    This molecule’s structure gives it unique properties. A bromine atom on the pyrimidine ring opens doors in cross-coupling reactions such as Suzuki and Buchwald-Hartwig, with methylthionyl groups offering distinct reactivity as well as extra handles for further modifications. Years spent in process development have shown me that every step can act as a bottleneck or a breakthrough, and using a compound like this one often means fewer steps and less purification hassle. Anyone who’s tried to patch together a synthetic sequence on deadline knows what a difference that makes.

    Specifications and What Really Matters on the Bench

    Too often, product pages drown users in abstract “purity” numbers or generic features, skipping over what actually makes a chemical useful in the lab. Time and again, my colleagues and I have found that specifications translate directly into real-world results. With 4-Bromo-2-(methylthionyl)pyrimidine, attention to details like melting point, solubility in common organic solvents, and reliability of the bromination are central. This compound is typically available at a laboratory scale as a fine, off-white to pale-yellow crystalline powder.

    The molecular formula — C5H4BrN2S — gives some hints about likely reactivity, but the real test comes with hands-on trials. Solubility in acetonitrile, dichloromethane, and even less polar solvents means fewer headaches when designing reaction conditions. Stability up to moderate temperatures, resistance to common acids and bases, and the lack of frequent decomposition issues mean a chemist can focus on the main task, not on baby-sitting a fragile intermediate. I’ve seen labs wrestle with less stable bromopyrimidines and end up replacing them mid-project; having one that stays reliable across a range of scales saves both time and resources.

    Other pyrimidine derivatives exist with different substitution patterns, offering either greater reactivity or higher selectivity in specific reactions. Yet, 4-Bromo-2-(methylthionyl)pyrimidine stands out for balancing both. Some chemists look for extreme niche functions, but more often, the goal is to push through key steps without gambling on unpredictable chemistry. Product quality—batch consistency, low level of side impurities, and ease of handling—remains vital. For any team scaling up reactions or moving from bench to pilot scale, these material details often dictate project feasibility.

    How Usage Guides Innovation in Drug Development and Discovery

    Across the drug discovery pipeline, the stakes rest on the ability to access tailored scaffolds efficiently. Medicinal chemists face mounting pressure to shorten discovery cycles and minimize resource waste. In this context, building blocks like 4-Bromo-2-(methylthionyl)pyrimidine prove their worth. They serve as starting points for constructing more involved molecular frameworks, particularly when searching for bioactive compounds in oncology, antivirals, and metabolic disease research.

    The bromine makes it a prime candidate for halogen-metal exchange or for installation of further functional moieties via palladium-catalyzed routes. Modifications on the pyrimidine scaffold, thanks to the combination of the bromine and methylthionyl groups, can help create analogues quickly, refining activity or improving pharmacokinetic profiles. This flexibility means chemists can rapidly build libraries of potential drug candidates, explore new chemical space, or improve binding affinities, hitting that sweet spot between innovation and practicality.

    Not every research group has endless budgets or time to waste on repeated purification and analysis steps. An intermediate like this pyrimidine derivative lends itself to straightforward workups and purification techniques—no need to hunt down special solvents or complicated chromatography spikes. People who’ve performed dozens or even hundreds of parallel syntheses appreciate materials that don’t stall mid-run or clog up high-throughput workflows. It’s not just about scaling up: it’s about surviving the day-to-day grind of exploratory research.

    Comparing 4-Bromo-2-(Methylthionyl)Pyrimidine to Other Common Building Blocks

    The landscape of pyrimidine derivatives gets crowded pretty fast: 2-bromopyrimidine, 4-chloro-2-(methylthionyl)pyrimidine, and related analogues each have their loyal following. These alternatives serve in similar roles, but subtle differences in electronic effects and steric profiles can nudge a synthetic project in one direction or another. Having direct experience with these compounds, I’ve noticed how swapping bromine for chlorine shifts reactivity and downstream yield consistently.

    For example, 2-bromopyrimidine sees frequent use in biaryl coupling but lacks the methylthionyl group, so it fits less cleanly in routes targeting thioether-linked pharmacophores. 4-Chloro-2-(methylthionyl)pyrimidine, another analog, reacts faster in some substitutions but often demands more careful control over reaction temperature, leading to tricky optimization for scale-up. By comparison, 4-Bromo-2-(methylthionyl)pyrimidine walks a fine line between offering halogen reactivity for further modification and the functional group variety essential for lead optimization.

    Material pricing fluctuates, but the cost/benefit ratio often tilts in favor of compounds that genuinely move projects forward rather than just padding a catalog. In reality, time and again, chemists revert to building blocks that combine synthetic flexibility with a record of reproducible results. I’ve personally participated in projects where a cheaper “alternative” compound promised easy substitutions, only to bog down in byproducts or side reactions that ate through budgets and patience alike. The added up-front cost of a well-behaved intermediate is quickly offset by savings in time, reagents, and labor.

    The Human Element: Decision-Making in Chemical Synthesis

    Chemistry often gets painted as a world of formulas, but the real story leans heavily on decision-making and risk management. Each step in a synthetic route involves weighing the trade-offs between expense, convenience, purity, and adaptability. 4-Bromo-2-(methylthionyl)pyrimidine isn’t just selected from a table—it shows up in research notebooks where deadlines and funding both loom large. Even the best-equipped laboratories can’t ignore the importance of clean, robust reactions when chasing patents or regulatory approval.

    Training new chemists, I’ve seen firsthand that their earliest successes often build on well-known scaffolds and intermediates. Working with reliable compounds lets them focus on optimizing new reactions and not fighting an uphill battle against unpredictable starting materials. A dependable pyrimidine builds confidence in junior staff, instilling a sense of progress that snowballs over time. Teams working under pressure gravitate towards reagents with a proven track record, and the performance of this particular compound earns it that loyalty.

    Collaboration across teams—medicinal, process, and analytical chemists—relies on shared knowledge of what works. Conversations between colleagues about what to use in a challenging Suzuki coupling or a late-stage thioether formation often circle back to a handful of reliable chemicals. 4-Bromo-2-(methylthionyl)pyrimidine features among these for many organizations. It’s not the flashiest molecule, but it helps cut through complexity and push research forward on a realistic schedule.

    Challenges and Responsible Use

    No commentary would be complete without addressing the challenges tied to frequent use of halogenated building blocks. Environmental concerns continue to push the chemical industry towards greener, safer approaches. Handling brominated compounds brings with it disposal requirements and a need for safe, ventilated workspaces to protect both researchers and the environment. Laboratories with strong compliance cultures find ways to minimize waste, recover solvents, and track the lifecycle of these intermediates.

    On both the academic and industrial side, growing emphasis on sustainability inspires efforts to find or design alternative syntheses for key intermediates. While 4-Bromo-2-(methylthionyl)pyrimidine remains entrenched in specific medicinal and agricultural projects, process teams regularly review and adjust protocols to lower overall environmental impact. I’ve worked with groups who sought to cut down on excess halogenated solvent use or to recycle reaction byproducts, demonstrating that responsible stewardship can walk alongside continued innovation.

    Worker safety dominates planning stages. Adequate training for anyone handling brominated reagents reduces accident rates and ensures safe completion of sensitive synthesis. The right personal protective equipment, effective fume extraction, and up-to-date procedures protect both individuals and organizations from avoidable setbacks. In busy labs, substituting hazardous intermediates only happens when no suitable alternative matches the performance and convenience offered by mainstays like this methylthionylpyrimidine.

    Fostering Innovation by Streamlining Synthetic Routes

    Innovation in chemistry flourishes when teams have freedom to experiment, try new methods, and pivot approaches quickly. Reliable intermediates cut down on the troubleshooting that can derail early exploration. By delivering predictable reactivity and straightforward handling, 4-Bromo-2-(methylthionyl)pyrimidine keeps the focus on creativity rather than damage control. As a researcher, I appreciate building a toolkit geared towards rapid progress—lots of academic breakthroughs and startup pipelines trace back to this kind of strategic choice in reagents.

    Having access to robust starting materials opens up the synthetic playbook. For example, cross-coupling reactions benefit from the selectivity and resilience this brominated pyrimidine brings. Researchers chasing new kinase inhibitors or antiviral nucleoside analogues find that one adaptable scaffold can lead to dozens of candidate molecules in a short time. Early attempts to swap in “green” or safer alternatives sometimes get hamstrung by unexpected losses of yield or extra purification steps. A careful balance between innovation and reliability keeps projects both sustainable and productive, even in the pressure-cooker environment of drug discovery.

    Theory only carries a team so far; hands-on experience bridges the gap. Over time, researchers collect mental checklists of which intermediates tend to save or sink projects. 4-Bromo-2-(methylthionyl)pyrimidine earns its stripes by not derailing work with unexpected side reactions or byproduct formation—something that can’t be said for every similar-looking compound. Peer recommendations and real project results matter far more than yet another page of data.

    Potential Solutions to the Pressures of Cost, Safety, and Sustainability

    While the need to streamline chemical synthesis remains constant, new ideas to meet the triple challenge of cost, safety, and sustainability continue to emerge. Advanced process optimization—using continuous flow techniques or automated microreactors—lets teams handle potent reagents on a smaller, safer scale while scaling up outputs as needed. Reaction monitoring gets an upgrade from modern analytical tools, driving better yields with less material waste.

    For 4-Bromo-2-(methylthionyl)pyrimidine and similar compounds, ongoing collaboration between suppliers and end-users ensures tighter control over quality and purity. Purchasing teams work closely with trusted suppliers, aiming for better batch-to-batch reproducibility and more accurate delivery timelines. One area with room for growth lies in supplier transparency about synthetic origin, trace metal content, and impurity profiles—these details pay dividends in both R&D and regulatory filings.

    Smarter waste management transforms how laboratories operate. Research teams pay closer attention to sustainable disposal, solvent recovery, and even reactivation of halogenated waste streams. These practices become second nature rather than afterthoughts, supporting both budget and environmental goals. Several large research institutions invest in centralized waste processing, integrating lessons learned from high-volume users of brominated intermediates.

    Continued education about the specific hazards and best practices working with such chemicals drives safer habits. Seasoned chemists pass along tips on minimizing exposure and navigating regulatory paperwork. For organizations pushing forward on ambitious synthetic campaigns, keeping pace with regulatory trends and developing internal protocols for hazardous material management build a foundation for both compliance and good science.

    Concluding Thoughts: Trust and Progress Go Hand in Hand

    Taking a step back, the importance of reliable, well-characterized building blocks like 4-Bromo-2-(methylthionyl)pyrimidine becomes clear. It forms more than just a reagent choice: it becomes a link in a chain of trust among researchers, suppliers, and downstream partners. I’ve watched enough projects ride or fall on the quality of their starting materials to know that careful decisions here resonate through every later stage.

    Science builds on consistent building blocks and clear communication. Every well-handled reaction, each successful batch, sets the stage for the next breakthrough. By supporting innovation while respecting safety and environmental concerns, compounds like 4-Bromo-2-(methylthionyl)pyrimidine help nudge the field of medicinal and process chemistry forward, one carefully chosen step at a time.